methanesulfonic acid; 2-(methylamino)propane-1,3-diol

Systemtic Name: methanesulfonic acid; 2-(methylamino)propane-1,3-diol Openeye Name: methanesulfonic acid; 2-(methylamino)propane-1,3-diol CAS Name: methanesulfonic acid; 2-(methylamino)propane-1,3-diol IUPAC Name: methanesulfonic acid; 2-(methylamino)propane-1,3-diol Traditional Name: mesylic acid; 2-(methylamino)propane-1,3-diol Formula: C5H15NO5S MolecularWeight: 201.2413

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Descriptors Computed from Structure

Canonical SMILES:

CNC(CO)CO.CS(=O)(=O)O

Isomeric SMILES

CNC(CO)CO.CS(=O)(=O)O

InChI

InChI=1S/C4H11NO2.CH4O3S/c1-5-4(2-6)3-7;1-5(2,3)4/h4-7H,2-3H2,1H3;1H3,(H,2,3,4)